SCHEMBL30457026

SCHEMBL30457026

O=C(Cl)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 5/20 0.33
ICAM1 P05362 5/20 0.33
ITGAL P20701 5/20 0.33
CPB2 Q96IY4 5/20 0.32
CPB1 P15086 1/20 0.32
MME P08473 1/20 0.31
TNF P01375 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
PIN1 Q13526 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1073717 0.88 ITGB2 (0.36) ITGB2ICAM1ITGALCPB2CPB1
SCHEMBL3378638 0.86 CPB2 (0.34) ITGB2ICAM1ITGALCPB2CPB1
SCHEMBL3378642 0.86 CPB2 (0.34) ITGB2ICAM1ITGALCPB2CPB1
SCHEMBL483799 0.85 SLC15A2 (0.42) CPB2CPB1PIN1
SCHEMBL28625902 0.85 KMT2A (0.42) ITGB2ICAM1ITGALCPB2CPB1
SCHEMBL1666820 0.85 SLC15A2 (0.42) CPB2CPB1PIN1
SCHEMBL28625900 0.85 KMT2A (0.42) ITGB2ICAM1ITGALCPB2CPB1
SCHEMBL5494120 0.85 CPB2 (0.34) ITGB2ICAM1ITGALCPB2CPB1
SCHEMBL6026424 0.85 ALOX15 (0.42) ITGB2ICAM1ITGALCPB2CPB1
SCHEMBL61370 0.85 ALOX15 (0.42) ITGB2ICAM1ITGALCPB2CPB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116254242-B ATP phosphonucleoside transferase mutant and corynebacterium glutamicum for producing L-histidine 江南大学 2024-01-30 CN disclosed
CN-116254242-A ATP phosphonucleoside transferase mutant and corynebacterium glutamicum for producing L-histidine 江南大学 2023-06-13 CN disclosed